Iron in PDB 4iub: Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1
Enzymatic activity of Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1
All present enzymatic activity of Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1:
1.12.5.1;
Protein crystallography data
The structure of Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1, PDB code: 4iub
was solved by
S.Frielingsdorf,
A.Schmidt,
J.Fritsch,
O.Lenz,
P.Scheerer,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
34.05 /
1.61
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
72.903,
95.390,
118.818,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
12.8 /
16.6
|
Other elements in 4iub:
The structure of Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1 also contains other interesting chemical elements:
Iron Binding Sites:
Pages:
>>> Page 1 <<<
Page 2, Binding sites: 11 -
12;
Binding sites:
The binding sites of Iron atom in the Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1
(pdb code 4iub). This binding sites where shown within
5.0 Angstroms radius around Iron atom.
In total 12 binding sites of Iron where determined in the
Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1, PDB code: 4iub:
Jump to Iron binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Iron binding site 1 out
of 12 in 4iub
Go back to
Iron Binding Sites List in 4iub
Iron binding site 1 out
of 12 in the Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 1 of Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
L:Fe701
b:8.5
occ:1.00
|
FE
|
L:NFV701
|
0.0
|
8.5
|
1.0
|
C1
|
L:NFV701
|
1.8
|
7.9
|
1.0
|
C2
|
L:NFV701
|
1.9
|
8.4
|
1.0
|
C3
|
L:NFV701
|
1.9
|
8.8
|
1.0
|
O4
|
L:NFV701
|
2.0
|
10.5
|
1.0
|
SG
|
L:CYS600
|
2.3
|
11.0
|
1.0
|
SG
|
L:CYS78
|
2.4
|
12.2
|
1.0
|
NI
|
L:NFV701
|
2.9
|
10.1
|
1.0
|
O1
|
L:NFV701
|
3.0
|
9.9
|
1.0
|
N2
|
L:NFV701
|
3.1
|
8.9
|
1.0
|
N3
|
L:NFV701
|
3.1
|
8.7
|
1.0
|
CB
|
L:CYS78
|
3.4
|
12.3
|
1.0
|
CB
|
L:CYS600
|
3.4
|
10.1
|
1.0
|
CG1
|
L:VAL551
|
4.2
|
10.7
|
1.0
|
CD
|
L:ARG530
|
4.2
|
11.2
|
1.0
|
NE2
|
L:HIS82
|
4.3
|
9.5
|
1.0
|
NH1
|
L:ARG530
|
4.3
|
12.2
|
1.0
|
SG
|
L:CYS81
|
4.4
|
12.9
|
1.0
|
CB
|
L:CYS597
|
4.4
|
12.4
|
1.0
|
SG
|
L:CYS597
|
4.4
|
13.9
|
1.0
|
CD
|
L:PRO552
|
4.7
|
8.6
|
1.0
|
CA
|
L:CYS600
|
4.8
|
8.5
|
1.0
|
CA
|
L:CYS78
|
4.8
|
12.7
|
1.0
|
SG
|
L:CYS75
|
4.8
|
13.7
|
1.0
|
CB
|
L:CYS75
|
4.9
|
11.1
|
1.0
|
CD2
|
L:HIS82
|
4.9
|
9.6
|
1.0
|
NE
|
L:ARG530
|
5.0
|
12.2
|
1.0
|
CG
|
L:PRO552
|
5.0
|
8.6
|
1.0
|
|
Iron binding site 2 out
of 12 in 4iub
Go back to
Iron Binding Sites List in 4iub
Iron binding site 2 out
of 12 in the Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 2 of Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
S:Fe1001
b:11.3
occ:1.00
|
FE1
|
S:SF41001
|
0.0
|
11.3
|
1.0
|
ND1
|
S:HIS187
|
2.1
|
11.9
|
1.0
|
S4
|
S:SF41001
|
2.2
|
11.0
|
1.0
|
S2
|
S:SF41001
|
2.3
|
11.8
|
1.0
|
S3
|
S:SF41001
|
2.3
|
10.7
|
1.0
|
FE3
|
S:SF41001
|
2.7
|
11.3
|
1.0
|
FE4
|
S:SF41001
|
2.7
|
10.9
|
1.0
|
FE2
|
S:SF41001
|
2.8
|
10.2
|
1.0
|
CE1
|
S:HIS187
|
2.9
|
13.8
|
1.0
|
CG
|
S:HIS187
|
3.2
|
14.8
|
1.0
|
CB
|
S:HIS187
|
3.6
|
14.2
|
1.0
|
S1
|
S:SF41001
|
3.9
|
10.3
|
1.0
|
CA
|
S:HIS187
|
3.9
|
13.4
|
1.0
|
NE2
|
S:HIS187
|
4.1
|
16.2
|
1.0
|
CG
|
S:PRO224
|
4.2
|
12.7
|
1.0
|
CD
|
S:PRO224
|
4.2
|
11.7
|
1.0
|
CD2
|
S:HIS187
|
4.2
|
15.9
|
1.0
|
CB
|
S:CYS190
|
4.6
|
12.6
|
1.0
|
SG
|
S:CYS215
|
4.6
|
11.0
|
1.0
|
O
|
S:HIS187
|
4.7
|
17.0
|
1.0
|
SG
|
S:CYS190
|
4.7
|
11.6
|
1.0
|
N
|
S:PRO224
|
4.8
|
11.6
|
1.0
|
CD2
|
S:PHE196
|
4.8
|
14.3
|
1.0
|
SG
|
S:CYS221
|
4.8
|
9.6
|
1.0
|
N
|
S:HIS187
|
4.8
|
11.9
|
1.0
|
C
|
S:HIS187
|
4.8
|
15.0
|
1.0
|
|
Iron binding site 3 out
of 12 in 4iub
Go back to
Iron Binding Sites List in 4iub
Iron binding site 3 out
of 12 in the Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 3 of Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
S:Fe1001
b:10.2
occ:1.00
|
FE2
|
S:SF41001
|
0.0
|
10.2
|
1.0
|
SG
|
S:CYS221
|
2.3
|
9.6
|
1.0
|
S3
|
S:SF41001
|
2.3
|
10.7
|
1.0
|
S4
|
S:SF41001
|
2.3
|
11.0
|
1.0
|
S1
|
S:SF41001
|
2.3
|
10.3
|
1.0
|
FE4
|
S:SF41001
|
2.7
|
10.9
|
1.0
|
FE1
|
S:SF41001
|
2.8
|
11.3
|
1.0
|
FE3
|
S:SF41001
|
2.8
|
11.3
|
1.0
|
CB
|
S:CYS221
|
3.2
|
9.0
|
1.0
|
S2
|
S:SF41001
|
3.9
|
11.8
|
1.0
|
CD1
|
S:ILE243
|
4.0
|
11.0
|
1.0
|
CG1
|
S:ILE243
|
4.4
|
10.6
|
1.0
|
CD
|
S:PRO224
|
4.4
|
11.7
|
1.0
|
N
|
S:GLY223
|
4.5
|
9.8
|
1.0
|
CA
|
S:GLY223
|
4.5
|
11.3
|
1.0
|
CA
|
S:CYS221
|
4.6
|
9.7
|
1.0
|
SG
|
S:CYS215
|
4.7
|
11.0
|
1.0
|
ND1
|
S:HIS187
|
4.7
|
11.9
|
1.0
|
N
|
S:TYR217
|
4.7
|
9.6
|
1.0
|
SG
|
S:CYS190
|
4.8
|
11.6
|
1.0
|
C
|
S:CYS221
|
4.8
|
9.5
|
1.0
|
N
|
S:LEU216
|
4.8
|
9.2
|
1.0
|
O
|
S:CYS221
|
4.9
|
9.9
|
1.0
|
C
|
S:LEU216
|
4.9
|
9.7
|
1.0
|
CB
|
S:LEU216
|
5.0
|
8.8
|
1.0
|
|
Iron binding site 4 out
of 12 in 4iub
Go back to
Iron Binding Sites List in 4iub
Iron binding site 4 out
of 12 in the Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 4 of Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
S:Fe1001
b:11.3
occ:1.00
|
FE3
|
S:SF41001
|
0.0
|
11.3
|
1.0
|
SG
|
S:CYS190
|
2.3
|
11.6
|
1.0
|
S2
|
S:SF41001
|
2.3
|
11.8
|
1.0
|
S1
|
S:SF41001
|
2.3
|
10.3
|
1.0
|
S4
|
S:SF41001
|
2.3
|
11.0
|
1.0
|
FE1
|
S:SF41001
|
2.7
|
11.3
|
1.0
|
FE2
|
S:SF41001
|
2.8
|
10.2
|
1.0
|
FE4
|
S:SF41001
|
2.8
|
10.9
|
1.0
|
CB
|
S:CYS190
|
3.1
|
12.6
|
1.0
|
S3
|
S:SF41001
|
3.9
|
10.7
|
1.0
|
CB
|
S:ARG192
|
4.1
|
11.9
|
1.0
|
CG2
|
S:ILE243
|
4.2
|
10.4
|
1.0
|
CD1
|
S:ILE243
|
4.3
|
11.0
|
1.0
|
CA
|
S:CYS190
|
4.5
|
12.3
|
1.0
|
ND1
|
S:HIS187
|
4.6
|
11.9
|
1.0
|
C
|
S:ARG192
|
4.7
|
14.4
|
1.0
|
N
|
S:ARG193
|
4.7
|
14.4
|
1.0
|
CG1
|
S:ILE243
|
4.7
|
10.6
|
1.0
|
CA
|
S:ARG192
|
4.7
|
12.9
|
1.0
|
N
|
S:ARG192
|
4.8
|
13.6
|
1.0
|
SG
|
S:CYS221
|
4.8
|
9.6
|
1.0
|
C
|
S:CYS190
|
4.9
|
12.8
|
1.0
|
CG
|
S:ARG192
|
5.0
|
10.9
|
1.0
|
SG
|
S:CYS215
|
5.0
|
11.0
|
1.0
|
CA
|
S:HIS187
|
5.0
|
13.4
|
1.0
|
|
Iron binding site 5 out
of 12 in 4iub
Go back to
Iron Binding Sites List in 4iub
Iron binding site 5 out
of 12 in the Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 5 of Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
S:Fe1001
b:10.9
occ:1.00
|
FE4
|
S:SF41001
|
0.0
|
10.9
|
1.0
|
S1
|
S:SF41001
|
2.2
|
10.3
|
1.0
|
S2
|
S:SF41001
|
2.3
|
11.8
|
1.0
|
S3
|
S:SF41001
|
2.3
|
10.7
|
1.0
|
SG
|
S:CYS215
|
2.3
|
11.0
|
1.0
|
FE2
|
S:SF41001
|
2.7
|
10.2
|
1.0
|
FE1
|
S:SF41001
|
2.7
|
11.3
|
1.0
|
FE3
|
S:SF41001
|
2.8
|
11.3
|
1.0
|
CB
|
S:CYS215
|
3.3
|
11.1
|
1.0
|
N
|
S:LEU216
|
3.7
|
9.2
|
1.0
|
S4
|
S:SF41001
|
3.9
|
11.0
|
1.0
|
CA
|
S:CYS215
|
3.9
|
10.3
|
1.0
|
N
|
S:TYR217
|
4.1
|
9.6
|
1.0
|
C
|
S:CYS215
|
4.2
|
10.3
|
1.0
|
CB
|
S:PHE196
|
4.3
|
13.2
|
1.0
|
CD2
|
S:PHE196
|
4.4
|
14.3
|
1.0
|
ND1
|
S:HIS187
|
4.5
|
11.9
|
1.0
|
CB
|
S:TYR217
|
4.6
|
11.8
|
1.0
|
CE1
|
S:HIS187
|
4.7
|
13.8
|
1.0
|
CB
|
S:ARG192
|
4.7
|
11.9
|
1.0
|
CA
|
S:LEU216
|
4.7
|
9.3
|
1.0
|
CG
|
S:PHE196
|
4.8
|
13.6
|
1.0
|
C
|
S:LEU216
|
4.8
|
9.7
|
1.0
|
CA
|
S:TYR217
|
4.8
|
10.4
|
1.0
|
SG
|
S:CYS221
|
4.8
|
9.6
|
1.0
|
O
|
S:ARG192
|
4.9
|
13.8
|
1.0
|
SG
|
S:CYS190
|
4.9
|
11.6
|
1.0
|
|
Iron binding site 6 out
of 12 in 4iub
Go back to
Iron Binding Sites List in 4iub
Iron binding site 6 out
of 12 in the Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 6 of Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
S:Fe1002
b:9.9
occ:1.00
|
FE1
|
S:F3S1002
|
0.0
|
9.9
|
1.0
|
S1
|
S:F3S1002
|
2.2
|
9.9
|
1.0
|
SG
|
S:CYS249
|
2.3
|
9.6
|
1.0
|
S2
|
S:F3S1002
|
2.3
|
9.6
|
1.0
|
S3
|
S:F3S1002
|
2.3
|
9.9
|
1.0
|
FE3
|
S:F3S1002
|
2.7
|
10.1
|
1.0
|
FE4
|
S:F3S1002
|
2.7
|
9.7
|
1.0
|
CB
|
S:CYS249
|
3.2
|
9.1
|
1.0
|
CA
|
S:CYS249
|
3.6
|
8.7
|
1.0
|
S4
|
S:F3S1002
|
3.9
|
9.5
|
1.0
|
N
|
S:ILE250
|
4.1
|
8.4
|
1.0
|
N
|
S:GLY251
|
4.2
|
9.1
|
1.0
|
C
|
S:CYS249
|
4.3
|
8.6
|
1.0
|
N
|
S:CYS252
|
4.4
|
8.8
|
1.0
|
CG2
|
S:THR226
|
4.5
|
11.0
|
1.0
|
CA
|
S:GLY251
|
4.7
|
9.0
|
1.0
|
CG1
|
S:ILE186
|
4.7
|
18.5
|
1.0
|
O
|
L:HOH891
|
4.8
|
23.6
|
1.0
|
SG
|
S:CYS252
|
4.8
|
9.5
|
1.0
|
SG
|
S:CYS230
|
4.8
|
10.2
|
1.0
|
CG
|
S:PRO242
|
4.9
|
9.1
|
1.0
|
N
|
S:CYS249
|
4.9
|
9.4
|
1.0
|
CD1
|
S:ILE186
|
4.9
|
21.0
|
1.0
|
|
Iron binding site 7 out
of 12 in 4iub
Go back to
Iron Binding Sites List in 4iub
Iron binding site 7 out
of 12 in the Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 7 of Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
S:Fe1002
b:10.1
occ:1.00
|
FE3
|
S:F3S1002
|
0.0
|
10.1
|
1.0
|
S1
|
S:F3S1002
|
2.2
|
9.9
|
1.0
|
S4
|
S:F3S1002
|
2.2
|
9.5
|
1.0
|
SG
|
S:CYS230
|
2.3
|
10.2
|
1.0
|
S3
|
S:F3S1002
|
2.3
|
9.9
|
1.0
|
FE1
|
S:F3S1002
|
2.7
|
9.9
|
1.0
|
FE4
|
S:F3S1002
|
2.7
|
9.7
|
1.0
|
CB
|
S:CYS230
|
3.3
|
10.7
|
1.0
|
S2
|
S:F3S1002
|
4.0
|
9.6
|
1.0
|
ND2
|
S:ASN228
|
4.0
|
12.5
|
1.0
|
NE1
|
S:TRP235
|
4.3
|
9.4
|
1.0
|
CD1
|
S:ILE186
|
4.3
|
21.0
|
1.0
|
O
|
S:HOH1172
|
4.4
|
10.5
|
1.0
|
CG
|
S:PRO242
|
4.5
|
9.1
|
1.0
|
CD
|
S:PRO242
|
4.6
|
8.8
|
1.0
|
CG
|
S:ASN228
|
4.6
|
11.9
|
1.0
|
CB
|
S:ASN228
|
4.6
|
11.3
|
1.0
|
CA
|
S:CYS230
|
4.7
|
11.0
|
1.0
|
SG
|
S:CYS252
|
4.8
|
9.5
|
1.0
|
SG
|
S:CYS249
|
4.8
|
9.6
|
1.0
|
CG1
|
S:ILE186
|
5.0
|
18.5
|
1.0
|
|
Iron binding site 8 out
of 12 in 4iub
Go back to
Iron Binding Sites List in 4iub
Iron binding site 8 out
of 12 in the Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 8 of Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
S:Fe1002
b:9.7
occ:1.00
|
FE4
|
S:F3S1002
|
0.0
|
9.7
|
1.0
|
S4
|
S:F3S1002
|
2.2
|
9.5
|
1.0
|
S2
|
S:F3S1002
|
2.3
|
9.6
|
1.0
|
SG
|
S:CYS252
|
2.3
|
9.5
|
1.0
|
S3
|
S:F3S1002
|
2.3
|
9.9
|
1.0
|
FE3
|
S:F3S1002
|
2.7
|
10.1
|
1.0
|
FE1
|
S:F3S1002
|
2.7
|
9.9
|
1.0
|
CB
|
S:CYS252
|
3.4
|
9.9
|
1.0
|
O
|
L:HOH847
|
3.8
|
12.8
|
1.0
|
N
|
S:CYS252
|
3.8
|
8.8
|
1.0
|
S1
|
S:F3S1002
|
3.9
|
9.9
|
1.0
|
O
|
S:HOH1172
|
4.0
|
10.5
|
1.0
|
NZ
|
L:LYS226
|
4.0
|
12.4
|
1.0
|
CA
|
S:CYS252
|
4.0
|
9.5
|
1.0
|
N
|
S:SER253
|
4.5
|
9.5
|
1.0
|
C
|
S:CYS252
|
4.6
|
10.3
|
1.0
|
ND2
|
S:ASN228
|
4.6
|
12.5
|
1.0
|
SG
|
S:CYS230
|
4.7
|
10.2
|
1.0
|
SG
|
S:CYS249
|
4.7
|
9.6
|
1.0
|
C
|
S:GLY251
|
5.0
|
8.9
|
1.0
|
O
|
L:HOH891
|
5.0
|
23.6
|
1.0
|
|
Iron binding site 9 out
of 12 in 4iub
Go back to
Iron Binding Sites List in 4iub
Iron binding site 9 out
of 12 in the Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 9 of Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
S:Fe1003
b:6.9
occ:1.00
|
FE2
|
S:S3F1003
|
0.0
|
6.9
|
1.0
|
S3
|
S:S3F1003
|
2.2
|
5.8
|
1.0
|
S1
|
S:S3F1003
|
2.3
|
7.2
|
1.0
|
SG
|
S:CYS115
|
2.3
|
12.1
|
1.0
|
S2
|
S:S3F1003
|
2.3
|
6.8
|
1.0
|
FE1
|
S:S3F1003
|
2.6
|
9.4
|
1.0
|
FE3
|
S:S3F1003
|
2.8
|
5.8
|
1.0
|
CB
|
S:CYS115
|
3.3
|
10.4
|
1.0
|
FE4
|
S:S3F1003
|
3.7
|
13.7
|
1.0
|
O
|
S:HOH1117
|
3.8
|
14.0
|
1.0
|
O1
|
S:S3F1003
|
3.8
|
10.8
|
0.9
|
SG
|
S:CYS19
|
4.0
|
11.1
|
1.0
|
N
|
S:CYS115
|
4.0
|
8.3
|
1.0
|
O
|
S:HOH1166
|
4.2
|
11.5
|
1.0
|
CA
|
S:CYS115
|
4.2
|
9.0
|
1.0
|
SG
|
S:CYS120
|
4.4
|
11.6
|
1.0
|
N
|
S:CYS17
|
4.5
|
9.7
|
1.0
|
CB
|
S:CYS120
|
4.6
|
11.2
|
1.0
|
SG
|
S:CYS20
|
4.6
|
11.9
|
1.0
|
SG
|
S:CYS17
|
4.6
|
11.4
|
1.0
|
SG
|
S:CYS149
|
4.7
|
10.3
|
1.0
|
CA
|
S:GLU16
|
4.8
|
11.1
|
0.5
|
CA
|
S:GLU16
|
4.9
|
11.3
|
0.5
|
CB
|
S:GLU16
|
5.0
|
12.3
|
0.5
|
|
Iron binding site 10 out
of 12 in 4iub
Go back to
Iron Binding Sites List in 4iub
Iron binding site 10 out
of 12 in the Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 10 of Crystal Structure of An O2-Tolerant [Nife]-Hydrogenase From Ralstonia Eutropha in Its As-Isolated Form - Oxidized State 1 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
S:Fe1003
b:5.8
occ:1.00
|
FE3
|
S:S3F1003
|
0.0
|
5.8
|
1.0
|
S3
|
S:S3F1003
|
2.2
|
5.8
|
1.0
|
S2
|
S:S3F1003
|
2.2
|
6.8
|
1.0
|
SG
|
S:CYS149
|
2.3
|
10.3
|
1.0
|
SG
|
S:CYS120
|
2.4
|
11.6
|
1.0
|
FE2
|
S:S3F1003
|
2.8
|
6.9
|
1.0
|
CB
|
S:CYS149
|
3.3
|
10.3
|
1.0
|
O1
|
S:S3F1003
|
3.4
|
10.8
|
0.9
|
FE1
|
S:S3F1003
|
3.5
|
9.4
|
1.0
|
CB
|
S:CYS120
|
3.5
|
11.2
|
1.0
|
SG
|
S:CYS115
|
4.0
|
12.1
|
1.0
|
CA
|
S:CYS149
|
4.0
|
9.0
|
1.0
|
SG
|
S:CYS19
|
4.3
|
11.1
|
1.0
|
CG
|
L:ARG73
|
4.3
|
10.1
|
1.0
|
CB
|
S:SER114
|
4.5
|
11.4
|
1.0
|
N
|
S:CYS115
|
4.5
|
8.3
|
1.0
|
S1
|
S:S3F1003
|
4.7
|
7.2
|
1.0
|
C
|
S:CYS149
|
4.9
|
9.2
|
1.0
|
O
|
S:GLY148
|
4.9
|
8.9
|
1.0
|
N
|
S:SER114
|
4.9
|
9.7
|
1.0
|
CA
|
S:CYS120
|
4.9
|
9.5
|
1.0
|
N
|
S:VAL121
|
5.0
|
9.6
|
1.0
|
|
Reference:
S.Frielingsdorf,
J.Fritsch,
A.Schmidt,
M.Hammer,
J.Lowenstein,
E.Siebert,
V.Pelmenschikov,
T.Jaenicke,
J.Kalms,
Y.Rippers,
F.Lendzian,
I.Zebger,
C.Teutloff,
M.Kaupp,
R.Bittl,
P.Hildebrandt,
B.Friedrich,
O.Lenz,
P.Scheerer.
Reversible [4FE-3S] Cluster Morphing in An O2-Tolerant [Nife] Hydrogenase. Nat.Chem.Biol. V. 10 378 2014.
ISSN: ISSN 1552-4450
PubMed: 24705592
DOI: 10.1038/NCHEMBIO.1500
Page generated: Mon Aug 5 04:15:02 2024
|